Rodríguez-Kessler PL - Search Results

1

Reactivity of Atomically Functionalized C-Doped Boron Nitride Nanoribbons and Their Interaction with Organosulfur Compounds.

Villanueva-Mejia F, Navarro-Santos P, Rodríguez-Kessler PL, Herrera-Bucio R, Rivera JL. Villanueva-Mejia F, et al. Nanomaterials (Basel). 2019 Mar 18;9(3):452. doi: 10.3390/nano9030452. Nanomaterials (Basel). 2019. PMID: 30889813 Free PMC article.

2

Correction: Structure effects of Pt₁₅ clusters for the oxygen reduction reaction: first-principles calculations.

Rodríguez-Kessler PL, Muñoz-Castro A, Rodríguez-Domínguez AR, Cabellos JL. Rodríguez-Kessler PL, et al. Phys Chem Chem Phys. 2023 Feb 15;25(7):5885. doi: 10.1039/d3cp90040a. Phys Chem Chem Phys. 2023. PMID: 36723247

3

Structural and electronic properties for Be-doped Pt_n (n = 1-12) clusters obtained by DFT calculations.

Rodríguez-Kessler PL, Rodríguez-Domínguez AR, Alonso-Dávila P, Navarro-Santos P, Muñoz-Castro A. Rodríguez-Kessler PL, et al. Phys Chem Chem Phys. 2022 Mar 30;24(13):7856-7861. doi: 10.1039/d1cp05410d. Phys Chem Chem Phys. 2022. PMID: 35302144

4

Size and structure effects of PtN (N = 12 - 13) clusters for the oxygen reduction reaction: First-principles calculations.

Rodríguez-Kessler PL, Rodríguez-Domínguez AR. Rodríguez-Kessler PL, et al. J Chem Phys. 2015 Nov 14;143(18):184312. doi: 10.1063/1.4935566. J Chem Phys. 2015. PMID: 26567667

5

Structures and Electronic Properties of TinV (n = 1-16) Clusters: First-Principles Calculations.

Rodríguez-Kessler PL, Rodríguez-Domínguez AR. Rodríguez-Kessler PL, et al. J Phys Chem A. 2016 Apr 21;120(15):2401-7. doi: 10.1021/acs.jpca.6b00224. Epub 2016 Apr 12. J Phys Chem A. 2016. PMID: 27043229

6

On the formation of spherical aromatic endohedral buckminsterfullerene. Evaluation of M@C₆₀ (M = Cr, Mo, W) from relativistic DFT calculations.

Rodríguez-Kessler PL, Charistos ND, King RB, Muñoz-Castro A. Rodríguez-Kessler PL, et al. Phys Chem Chem Phys. 2020 Jul 1;22(25):14268-14275. doi: 10.1039/d0cp02475a. Phys Chem Chem Phys. 2020. PMID: 32555845

7

Systematic cluster growth: a structure search method for transition metal clusters.

Rodríguez-Kessler PL , Rodríguez-Domínguez AR , Muñoz-Castro A . Rodríguez-Kessler PL , et al. Phys Chem Chem Phys. 2021 Feb 28;23(8):4935-4943. doi: 10.1039/d0cp06179d. Epub 2021 Feb 23. Phys Chem Chem Phys. 2021. PMID: 33621288

8

On the structure and reactivity of Pt_nCu_n (n = 1-7) alloy clusters.

Rodríguez-Kessler PL , Rodríguez-Domínguez AR , Muñoz-Castro A . Rodríguez-Kessler PL , et al. Phys Chem Chem Phys. 2021 Mar 28;23(12):7233-7239. doi: 10.1039/d1cp00379h. Epub 2021 Mar 19. Phys Chem Chem Phys. 2021. PMID: 33876083

9

On Heteronuclear Isoelectronic Alternatives to [Au₁₃(dppe)₅Cl₂]³⁺: Electronic and Optical Properties of the 18-Electron Os@[Au₁₂(dppe)₅Cl₂] Cluster from Relativistic Density Functional Theory Computations.

Wei J, Rodríguez-Kessler PL, Halet JF, Kahlal S, Saillard JY, Muñoz-Castro A. Wei J, et al. Inorg Chem. 2021 Jun 7;60(11):8173-8180. doi: 10.1021/acs.inorgchem.1c00799. Epub 2021 May 25. Inorg Chem. 2021. PMID: 34033476 Free article.

10

Reply to 'Comment on "Structural characterization, reactivity, and vibrational properties of silver clusters: A new global minimum for Ag₁₆"' by P. V. Nhat, N. T. Si, L. V. Duong and M. T. Nguyen, Phys. Chem. Chem. Phys., 2021, 23, DOI: D1CP00646K.

Rodríguez-Kessler PL, Rodríguez-Domínguez AR, MacLeod-Carey D, Muñoz-Castro A. Rodríguez-Kessler PL, et al. Phys Chem Chem Phys. 2021 Jun 9;23(22):12904-12906. doi: 10.1039/d1cp01481a. Phys Chem Chem Phys. 2021. PMID: 34042926

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